(NZ)-N-[3,4-dihydro-2H-quinolin-1-yl-[6-methyl-2-[(2-methylphenyl)methoxy]-3-pyridinyl]methylidene]hydroxylamine

C24H25N3O2 — CID 56679287

About (NZ)-N-[3,4-dihydro-2H-quinolin-1-yl-[6-methyl-2-[(2-methylphenyl)methoxy]-3-pyridinyl]methylidene]hydroxylamine

(NZ)-N-[3,4-dihydro-2H-quinolin-1-yl-[6-methyl-2-[(2-methylphenyl)methoxy]-3-pyridinyl]methylidene]hydroxylamine (PubChem CID 56679287) has the molecular formula C24H25N3O2 and a molecular weight of 387.48 g/mol. Its IUPAC name is (NZ)-N-[3,4-dihydro-2H-quinolin-1-yl-[6-methyl-2-[(2-methylphenyl)methoxy]-3-pyridinyl]methylidene]hydroxylamine.

Molecular Properties

• Compound Name: (NZ)-N-[3,4-dihydro-2H-quinolin-1-yl-[6-methyl-2-[(2-methylphenyl)methoxy]-3-pyridinyl]methylidene]hydroxylamine
• PubChem CID: 56679287
• Molecular Formula: C24H25N3O2
• Molecular Weight: 387.48 g/mol
• Exact Mass: 387.19
• IUPAC Name: (NZ)-N-[3,4-dihydro-2H-quinolin-1-yl-[6-methyl-2-[(2-methylphenyl)methoxy]-3-pyridinyl]methylidene]hydroxylamine
• SMILES: Cc1ccc(/C(=N/O)N2CCCc3ccccc32)c(OCc2ccccc2C)n1
• InChI: InChI=1S/C24H25N3O2/c1-17-8-3-4-10-20(17)16-29-24-21(14-13-18(2)25-24)23(26-28)27-15-7-11-19-9-5-6-12-22(19)27/h3-6,8-10,12-14,28H,7,11,15-16H2,1-2H3/b26-23-
• InChIKey: GECVSZGXPZHPSU-RWEWTDSWSA-N
• XLogP: 4.87
• TPSA: 57.95 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 4
• Heavy Atoms: 29
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	387.48
LogP ≤ 5	4.87
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (NZ)-N-[3,4-dihydro-2H-quinolin-1-yl-[6-methyl-2-[(2-methylphenyl)methoxy]-3-pyridinyl]methylidene]hydroxylamine?

The IUPAC name of (NZ)-N-[3,4-dihydro-2H-quinolin-1-yl-[6-methyl-2-[(2-methylphenyl)methoxy]-3-pyridinyl]methylidene]hydroxylamine (CID 56679287) is (NZ)-N-[3,4-dihydro-2H-quinolin-1-yl-[6-methyl-2-[(2-methylphenyl)methoxy]-3-pyridinyl]methylidene]hydroxylamine.

What is the SMILES notation for (NZ)-N-[3,4-dihydro-2H-quinolin-1-yl-[6-methyl-2-[(2-methylphenyl)methoxy]-3-pyridinyl]methylidene]hydroxylamine?

The canonical SMILES for (NZ)-N-[3,4-dihydro-2H-quinolin-1-yl-[6-methyl-2-[(2-methylphenyl)methoxy]-3-pyridinyl]methylidene]hydroxylamine is Cc1ccc(/C(=N/O)N2CCCc3ccccc32)c(OCc2ccccc2C)n1.

What is the InChIKey of (NZ)-N-[3,4-dihydro-2H-quinolin-1-yl-[6-methyl-2-[(2-methylphenyl)methoxy]-3-pyridinyl]methylidene]hydroxylamine?

The InChIKey is GECVSZGXPZHPSU-RWEWTDSWSA-N. The full InChI is InChI=1S/C24H25N3O2/c1-17-8-3-4-10-20(17)16-29-24-21(14-13-18(2)25-24)23(26-28)27-15-7-11-19-9-5-6-12-22(19)27/h3-6,8-10,12-14,28H,7,11,15-16H2,1-2H3/b26-23-.

What are the key properties of (NZ)-N-[3,4-dihydro-2H-quinolin-1-yl-[6-methyl-2-[(2-methylphenyl)methoxy]-3-pyridinyl]methylidene]hydroxylamine?

(NZ)-N-[3,4-dihydro-2H-quinolin-1-yl-[6-methyl-2-[(2-methylphenyl)methoxy]-3-pyridinyl]methylidene]hydroxylamine has a molecular weight of 387.48 g/mol, XLogP of 4.87, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for (NZ)-N-[3,4-dihydro-2H-quinolin-1-yl-[6-methyl-2-[(2-methylphenyl)methoxy]-3-pyridinyl]methylidene]hydroxylamine is sourced from PubChem (CID 56679287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).